N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-3,4-dimethylbenzamide
Chemical Structure Depiction of
N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-3,4-dimethylbenzamide
N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-3,4-dimethylbenzamide
Compound characteristics
| Compound ID: | L087-1388 |
| Compound Name: | N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-3,4-dimethylbenzamide |
| Molecular Weight: | 437.34 |
| Molecular Formula: | C22 H21 Br N4 O |
| Smiles: | Cc1ccc(cc1C)C(NC(/NCc1cccnc1)=N/c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5738 |
| logD: | 4.5352 |
| logSw: | -4.0847 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.369 |
| InChI Key: | VHPCIAOIXCNNDD-UHFFFAOYSA-N |